7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide

C20H20N2O4 — CID 92643178

IUPAC7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide
SMILESCOc1cccc2cc(C(=O)Nc3ccccc3C(=O)NC(C)C)oc12
InChIInChI=1S/C20H20N2O4/c1-12(2)21-19(23)14-8-4-5-9-15(14)22-20(24)17-11-13-7-6-10-16(25-3)18(13)26-17/h4-12H,1-3H3,(H,21,23)(H,22,24)
InChIKeyAFCFHUUHDQMDGB-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.83
Rot. Bonds5

About 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide

7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide (PubChem CID 92643178) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide
PubChem CID92643178
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC Name7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide
SMILESCOc1cccc2cc(C(=O)Nc3ccccc3C(=O)NC(C)C)oc12
InChIInChI=1S/C20H20N2O4/c1-12(2)21-19(23)14-8-4-5-9-15(14)22-20(24)17-11-13-7-6-10-16(25-3)18(13)26-17/h4-12H,1-3H3,(H,21,23)(H,22,24)
InChIKeyAFCFHUUHDQMDGB-UHFFFAOYSA-N
XLogP3.83
TPSA80.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

7-methoxy-N-(2-propan-2-yloxyphenyl)-1-benzofuran-2-carboxamide
CID 53281729
N-(3-chloro-2-methylphenyl)-7-methoxy-1-benzofuran-2-carboxamide
CID 78869079
7-methoxy-N-methyl-1-benzofuran-2-carboxamide
CID 53281820
N-(4-aminopyrimidin-5-yl)-7-methoxy-1-benzofuran-2-carboxamide
CID 91527109
7-methoxy-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide
CID 40888387
7-methoxy-N-[1-(4-methylphenyl)ethyl]-1-benzofuran-2-carboxamide
CID 53281692
N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 94012379
N-(2,4-dimethoxypyrimidin-5-yl)-7-methoxy-1-benzofuran-2-carboxamide
CID 122304022
3-[(7-methoxy-1-benzofuran-2-carbonyl)amino]benzoic acid
CID 124688750
7-ethoxy-N-naphthalen-1-yl-1-benzofuran-2-carboxamide
CID 40888860
(2S)-2-[(8-methoxy-2-oxochromene-3-carbonyl)amino]propanoic acid
CID 10493768
N-[1-(4-ethylphenyl)ethyl]-7-methoxy-1-benzofuran-2-carboxamide
CID 133178584

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide?
The IUPAC name of 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide (CID 92643178) is 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide is COc1cccc2cc(C(=O)Nc3ccccc3C(=O)NC(C)C)oc12.
What is the InChIKey of 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide?
The InChIKey is AFCFHUUHDQMDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-12(2)21-19(23)14-8-4-5-9-15(14)22-20(24)17-11-13-7-6-10-16(25-3)18(13)26-17/h4-12H,1-3H3,(H,21,23)(H,22,24).
What are the key properties of 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide?
7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 3.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-N-[2-(propan-2-ylcarbamoyl)phenyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 92643178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).